3-[(2-ethylphenyl)amino]-1-pyrimidin-2-yl-6,7-dihydro-5H-indazol-4-one

Systemtic Name: 3-[(2-ethylphenyl)amino]-1-pyrimidin-2-yl-6,7-dihydro-5H-indazol-4-one Openeye Name: 3-(2-ethylanilino)-1-pyrimidin-2-yl-6,7-dihydro-5H-indazol-4-one CAS Name: 3-(2-ethylanilino)-1-(2-pyrimidinyl)-6,7-dihydro-5H-indazol-4-one IUPAC Name: 3-(2-ethylanilino)-1-pyrimidin-2-yl-6,7-dihydro-5H-indazol-4-one Traditional Name: 3-(2-ethylanilino)-1-(2-pyrimidyl)-6,7-dihydro-5H-indazol-4-one Formula: C19H19N5O MolecularWeight: 333.38706

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NN(C3=C2C(=O)CCC3)C4=NC=CC=N4

Isomeric SMILES

CCC1=CC=CC=C1NC2=NN(C3=C2C(=O)CCC3)C4=NC=CC=N4

InChI

InChI=1S/C19H19N5O/c1-2-13-7-3-4-8-14(13)22-18-17-15(9-5-10-16(17)25)24(23-18)19-20-11-6-12-21-19/h3-4,6-8,11-12H,2,5,9-10H2,1H3,(H,22,23)